| SpectraBase Compound ID | 7tSE0AINeQ0 |
|---|---|
| InChI | InChI=1S/C29H46O5/c1-24(2)13-14-29(23(32)33)18(15-24)17-7-8-19-25(3)11-10-21(30)28(6,34)20(25)9-12-26(19,4)27(17,5)16-22(29)31/h7,18-22,30-31,34H,8-16H2,1-6H3,(H,32,33)/t18?,19?,20?,21-,22+,25+,26+,27+,28-,29+/m0/s1 |
| InChIKey | RKXJRRJVPGLACY-IXXCBBLGSA-N |
| Mol Weight | 474.7 g/mol |
| Molecular Formula | C29H46O5 |
| Exact Mass | 474.334525 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8FKIDQbaXq1 |
|---|---|
| Name | SAGETALIC-ACID;3-BETA,4-ALPHA,16-ALPHA-TRIHYDROXY-23-NOROLEAN-12-EN-28-OIC-ACID |
| Compound Number | 6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C29H46O5 |
| InChI | InChI=1S/C29H46O5/c1-24(2)13-14-29(23(32)33)18(15-24)17-7-8-19-25(3)11-10-21(30)28(6,34)20(25)9-12-26(19,4)27(17,5)16-22(29)31/h7,18-22,30-31,34H,8-16H2,1-6H3,(H,32,33)/t18?,19?,20?,21-,22+,25+,26+,27+,28-,29+/m0/s1 |
| InChIKey | RKXJRRJVPGLACY-IXXCBBLGSA-N |
| Literature Reference Author | Z.JIA,K.KOIKE,M.KUDO,H.LI,T.NIKAIDO |
| Literature Reference Citation | PHYTOCHEM.,48,529(1998) |
| Literature Reference DOI | 10.1016/S0031-9422(97)01128-X |
| Molecular Weight | 474.681 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWMS1074 |